U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ACHIRAL
Molecular Formula C4H6Cl2O2
Molecular Weight 156.995
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 2,2-Dichlorobutanoic acid

SMILES

CCC(Cl)(Cl)C(O)=O

InChI

InChIKey=OBLYWUBMZGHQDN-UHFFFAOYSA-N
InChI=1S/C4H6Cl2O2/c1-2-4(5,6)3(7)8/h2H2,1H3,(H,7,8)

HIDE SMILES / InChI

Molecular Formula C4H6Cl2O2
Molecular Weight 156.995
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Mon Mar 31 22:21:07 GMT 2025
Edited
by admin
on Mon Mar 31 22:21:07 GMT 2025
Record UNII
7KMA34C9N2
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
2,2-Dichlorobutanoic acid
Systematic Name English
Butanoic acid, 2,2-dichloro-
Preferred Name English
Code System Code Type Description
CAS
13023-00-2
Created by admin on Mon Mar 31 22:21:07 GMT 2025 , Edited by admin on Mon Mar 31 22:21:07 GMT 2025
PRIMARY
FDA UNII
7KMA34C9N2
Created by admin on Mon Mar 31 22:21:07 GMT 2025 , Edited by admin on Mon Mar 31 22:21:07 GMT 2025
PRIMARY
PUBCHEM
17290
Created by admin on Mon Mar 31 22:21:07 GMT 2025 , Edited by admin on Mon Mar 31 22:21:07 GMT 2025
PRIMARY
EPA CompTox
DTXSID8021567
Created by admin on Mon Mar 31 22:21:07 GMT 2025 , Edited by admin on Mon Mar 31 22:21:07 GMT 2025
PRIMARY